1-(2-thiophen-2-ylsulfanylethanoyl)piperidine-3-carboxylic acid

Systemtic Name: 1-(2-thiophen-2-ylsulfanylethanoyl)piperidine-3-carboxylic acid Openeye Name: 1-[2-(2-thienylsulfanyl)acetyl]piperidine-3-carboxylic acid CAS Name: 1-[1-oxo-2-(thiophen-2-ylthio)ethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(2-thiophen-2-ylsulfanylacetyl)piperidine-3-carboxylic acid Traditional Name: 1-[2-(2-thienylthio)acetyl]nipecotic acid Formula: C12H15NO3S2 MolecularWeight: 285.3824

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=CC=CS2)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)CSC2=CC=CS2)C(=O)O

InChI

InChI=1S/C12H15NO3S2/c14-10(8-18-11-4-2-6-17-11)13-5-1-3-9(7-13)12(15)16/h2,4,6,9H,1,3,5,7-8H2,(H,15,16)